2-(6-methylpyridin-2-yl)ethyl-[[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: 2-(6-methylpyridin-2-yl)ethyl-[[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl-[2-(6-methyl-2-pyridyl)ethyl]ammonium CAS Name: [4-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl-[2-(6-methyl-2-pyridinyl)ethyl]ammonium IUPAC Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl-[2-(6-methylpyridin-2-yl)ethyl]azanium Traditional Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-[2-(6-methyl-2-pyridyl)ethyl]ammonium Formula: C23H35N3O2+2 MolecularWeight: 385.5429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CC[NH2+]CC2=CC=C(C=C2)OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

CC1=NC(=CC=C1)CC[NH2+]CC2=CC=C(C=C2)OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C23H33N3O2/c1-19-6-5-7-21(25-19)12-13-24-16-20-8-10-23(11-9-20)28-18-22(27)17-26-14-3-2-4-15-26/h5-11,22,24,27H,2-4,12-18H2,1H3/p+2/t22-/m1/s1